BDBM50272854 1-(3-chlorophenyl)-3-(3-(1-ethyl-4-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1H-pyrazol-3-yl)phenyl)urea::CHEMBL497484

SMILES: CCn1cc(c(n1)-c1cccc(NC(=O)Nc2cccc(Cl)c2)c1)-c1ccnc2[nH]ccc12

InChI Key: InChIKey=XWRQRFRLQKTFJA-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50272854   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Serine/threonine-protein kinase B-raf (Homo sapiens (Human))	BDBM50272854 (1-(3-chlorophenyl)-3-(3-(1-ethyl-4-(1H-pyrrolo[2,3...) Show SMILES CCn1cc(c(n1)-c1cccc(NC(=O)Nc2cccc(Cl)c2)c1)-c1ccnc2[nH]ccc12 Show InChI InChI=1S/C25H21ClN6O/c1-2-32-15-22(20-9-11-27-24-21(20)10-12-28-24)23(31-32)16-5-3-7-18(13-16)29-25(33)30-19-8-4-6-17(26)14-19/h3-15H,2H2,1H3,(H,27,28)(H2,29,30,33)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	10.5	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of B-Raf by fluorescence anisotropy binding assay				Bioorg Med Chem Lett 18: 4610-4 (2008) Article DOI: 10.1016/j.bmcl.2008.07.019 BindingDB Entry DOI: 10.7270/Q21N821S
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